3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride

C103H110Cl4N28O17 — CID 159591538

About 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride

3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride (PubChem CID 159591538) has the molecular formula C103H110Cl4N28O17 and a molecular weight of 2154.00 g/mol. Its IUPAC name is 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride.

Molecular Properties

• Compound Name: 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride
• PubChem CID: 159591538
• Molecular Formula: C103H110Cl4N28O17
• Molecular Weight: 2154.00 g/mol
• Exact Mass: 2150.74
• IUPAC Name: 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride
• SMILES: C.C#CC(=O)OCC.CCOC(=O)c1cn(Cc2cn3cc(C4CC4)cc(C4(O)COC4)c3n2)nn1.Cl.NCc1ncn2ccc(Cl)cc12.O=C(NCc1ncn2ccc(Cl)cc12)c1cn(Cc2cn3cc(C4CC4)cc(C4(O)COC4)c3n2)nn1.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(C4(O)COC4)c3n2)nn1.OC1(c2cc(C3CC3)cn3cc(CCl)nc23)COC1.[N-]=[N+]=NCc1cn2cc(C3CC3)cc(C3(O)COC3)c2n1
• InChI: InChI=1S/C25H23ClN8O3.C19H21N5O4.C17H17N5O4.C14H15ClN2O2.C14H15N5O2.C8H8ClN3.C5H6O2.CH4.ClH/c26-17-3-4-32-14-28-20(22(32)6-17)7-27-24(35)21-11-34(31-30-21)10-18-9-33-8-16(15-1-2-15)5-19(23(33)29-18)25(36)12-37-13-25;1-2-28-18(25)16-9-24(22-21-16)8-14-7-23-6-13(12-3-4-12)5-15(17(23)20-14)19(26)10-27-11-19;23-16(24)14-7-22(20-19-14)6-12-5-21-4-11(10-1-2-10)3-13(15(21)18-12)17(25)8-26-9-17;15-4-11-6-17-5-10(9-1-2-9)3-12(13(17)16-11)14(18)7-19-8-14;15-18-16-4-11-6-19-5-10(9-1-2-9)3-12(13(19)17-11)14(20)7-21-8-14;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-3-5(6)7-4-2;;/h3-6,8-9,11,14-15,36H,1-2,7,10,12-13H2,(H,27,35);5-7,9,12,26H,2-4,8,10-11H2,1H3;3-5,7,10,25H,1-2,6,8-9H2,(H,23,24);3,5-6,9,18H,1-2,4,7-8H2;3,5-6,9,20H,1-2,4,7-8H2;1-3,5H,4,10H2;1H,4H2,2H3;1H4;1H
• InChIKey: VMDRZBHCWCHBGR-UHFFFAOYSA-N
• XLogP: 11.41
• TPSA: 554.31 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 41
• Rotatable Bonds: 27
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2154.00
LogP ≤ 5	11.41
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_5', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride?

The IUPAC name of 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride (CID 159591538) is 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride.

What is the SMILES notation for 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride?

The canonical SMILES for 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride is C.C#CC(=O)OCC.CCOC(=O)c1cn(Cc2cn3cc(C4CC4)cc(C4(O)COC4)c3n2)nn1.Cl.NCc1ncn2ccc(Cl)cc12.O=C(NCc1ncn2ccc(Cl)cc12)c1cn(Cc2cn3cc(C4CC4)cc(C4(O)COC4)c3n2)nn1.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(C4(O)COC4)c3n2)nn1.OC1(c2cc(C3CC3)cn3cc(CCl)nc23)COC1.[N-]=[N+]=NCc1cn2cc(C3CC3)cc(C3(O)COC3)c2n1.

What is the InChIKey of 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride?

The InChIKey is VMDRZBHCWCHBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23ClN8O3.C19H21N5O4.C17H17N5O4.C14H15ClN2O2.C14H15N5O2.C8H8ClN3.C5H6O2.CH4.ClH/c26-17-3-4-32-14-28-20(22(32)6-17)7-27-24(35)21-11-34(31-30-21)10-18-9-33-8-16(15-1-2-15)5-19(23(33)29-18)25(36)12-37-13-25;1-2-28-18(25)16-9-24(22-21-16)8-14-7-23-6-13(12-3-4-12)5-15(17(23)20-14)19(26)10-27-11-19;23-16(24)14-7-22(20-19-14)6-12-5-21-4-11(10-1-2-10)3-13(15(21)18-12)17(25)8-26-9-17;15-4-11-6-17-5-10(9-1-2-9)3-12(13(17)16-11)14(18)7-19-8-14;15-18-16-4-11-6-19-5-10(9-1-2-9)3-12(13(19)17-11)14(20)7-21-8-14;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-3-5(6)7-4-2;;/h3-6,8-9,11,14-15,36H,1-2,7,10,12-13H2,(H,27,35);5-7,9,12,26H,2-4,8,10-11H2,1H3;3-5,7,10,25H,1-2,6,8-9H2,(H,23,24);3,5-6,9,18H,1-2,4,7-8H2;3,5-6,9,20H,1-2,4,7-8H2;1-3,5H,4,10H2;1H,4H2,2H3;1H4;1H.

What are the key properties of 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride?

3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride has a molecular weight of 2154.00 g/mol, XLogP of 11.41, 27 rotatable bonds, 8 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;3-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]oxetan-3-ol;1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[6-cyclopropyl-8-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate;methane;hydrochloride is sourced from PubChem (CID 159591538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).